1-[(E)-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-[(E)-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea Formula: C23H19N5O2S MolecularWeight: 429.49426

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=CC1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4

Isomeric SMILES

C=CCNC(=S)N/N=C/C1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C23H19N5O2S/c1-2-12-24-23(31)26-25-14-17-15-28(18-9-4-3-5-10-18)27-21(17)19-13-16-8-6-7-11-20(16)30-22(19)29/h2-11,13-15H,1,12H2,(H2,24,26,31)/b25-14+